It is very simple in unix to concatenate files:
cat file1 file2 file3 > concatenated_file
The script should probably run just fine on this, but if you're not careful
it may include the "average" printout from each mdout file.
Good luck!
Jason
On Thu, Apr 29, 2010 at 5:29 PM, Homa Azizian <homa.azizian.anu.edu.au>wrote:
> Hi Bill,
> I want to rejoin the out files in order to have one file to examine the
> data by procese_mdout.pl to obtain e.g. ETOT, Temperature,... otherwise I
> think donig separately may force me to attach and paste it in to one file?
> Isn't it?
>
> ----- Original Message -----
> From: Bill Miller III <brmilleriii.gmail.com>
> Date: Thursday, April 29, 2010 2:37 pm
> Subject: Re: [AMBER] joining out files
> To: AMBER Mailing List <amber.ambermd.org>
>
> > Correct. ptraj will not allow you to trajin mdout files for
> > concatenation.What exactly are you trying to do?
> >
> > -Bill
> >
> > On Thu, Apr 29, 2010 at 7:03 AM, Homa Azizian
> > <homa.azizian.anu.edu.au>wrote:
> > >
> > >
> > > Hi,
> > > I want to rejoin the .out files from separate md
> > calculation. It
> > > seems thar trajin does not work for out file. How could I do this
> > > Thank's for helping
> > > Homa
> > >
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> > >
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--
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Graduate Student
352-392-4032
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Received on Thu Apr 29 2010 - 15:00:03 PDT
